(4-methanoylphenyl) 4-chloranyl-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: (4-methanoylphenyl) 4-chloranyl-1-ethyl-pyrazole-3-carboxylate Openeye Name: (4-formylphenyl) 4-chloro-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1-ethyl-3-pyrazolecarboxylic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) 4-chloro-1-ethylpyrazole-3-carboxylate Traditional Name: 4-chloro-1-ethyl-pyrazole-3-carboxylic acid (4-formylphenyl) ester Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC2=CC=C(C=C2)C=O)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC2=CC=C(C=C2)C=O)Cl

InChI

InChI=1S/C13H11ClN2O3/c1-2-16-7-11(14)12(15-16)13(18)19-10-5-3-9(8-17)4-6-10/h3-8H,2H2,1H3